methyl 1-(3-bromanylpyridin-4-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-naphthalene-2-carboxylate

Systemtic Name: methyl 1-(3-bromanylpyridin-4-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-naphthalene-2-carboxylate Openeye Name: methyl 1-(3-bromo-4-pyridyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxy-naphthalene-2-carboxylate CAS Name: 1-(3-bromo-4-pyridinyl)-3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-6,7-dimethoxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromopyridin-4-yl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxynaphthalene-2-carboxylate Traditional Name: 1-(3-bromo-4-pyridyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxy-naphthalene-2-carboxylic acid methyl ester Formula: C26H28BrN3O6 MolecularWeight: 558.42102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=C(C=NC=C3)Br)C(=O)OC)C(=O)N4CCN(CC4)CCO

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=C(C=NC=C3)Br)C(=O)OC)C(=O)N4CCN(CC4)CCO

InChI

InChI=1S/C26H28BrN3O6/c1-34-21-13-16-12-19(25(32)30-8-6-29(7-9-30)10-11-31)24(26(33)36-3)23(18(16)14-22(21)35-2)17-4-5-28-15-20(17)27/h4-5,12-15,31H,6-11H2,1-3H3